Nonadiabatic dynamics simulations for photoinduced processes in molecules and semiconductors: Methodologies and applications
Nonadiabatic dynamics (NAMD) simulations have become powerful tools for elucidating
complicated photoinduced processes in various systems from molecules to semiconductor …
complicated photoinduced processes in various systems from molecules to semiconductor …
Charge-delocalized state and coherent vibrational dynamics in rigid PBI H-aggregates
Herein, the ultrafast photoinduced dynamics and vibrational coherences for two
perylenebisimide (PBI) H-aggregates showcase the formation of the excimer state and the …
perylenebisimide (PBI) H-aggregates showcase the formation of the excimer state and the …
Sub-50 fs Formation of Charge Transfer States Rules the Fate of Photoexcitations in Eumelanin-Like Materials
V Petropoulos, A Mavridi-Printezi… - The Journal of …, 2024 - ACS Publications
Eumelanins play a crucial role as photoprotective agents for living organisms, yet the nature
of the stationary and transient species involved in the light absorption and deactivation …
of the stationary and transient species involved in the light absorption and deactivation …
Real‐time observation of structural dynamics triggering excimer formation in a perylene bisimide folda‐dimer by ultrafast time‐domain Raman spectroscopy
In π‐conjugated organic photovoltaic materials, an excimer state has been generally
regarded as a trap state which hinders efficient excitation energy transport. But despite wide …
regarded as a trap state which hinders efficient excitation energy transport. But despite wide …
Ultrafast and coherent dynamics in a solvent switchable “pink box” perylene diimide dimer
G Bressan, SE Penty, J Zheng, J Peng, Y **e, Y Long, X Ning… - Physical Chemistry …, 2020 - pubs.rsc.org
The exciton dynamics in one-dimensional stacked PBI (Perylene Bisimide) aggregates was
studied with SQC-MM dynamics (Symmetrical Quasiclassical Dynamics based on the Meyer …
studied with SQC-MM dynamics (Symmetrical Quasiclassical Dynamics based on the Meyer …